4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine

C26H50N4O5 — CID 54294580

IUPAC4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine
SMILESCCC(N1CCOCC1)C(C)(OC(C)(C(CC)N1CCOCC1)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C26H50N4O5/c1-5-23(27-7-15-31-16-8-27)25(3,29-11-19-33-20-12-29)35-26(4,30-13-21-34-22-14-30)24(6-2)28-9-17-32-18-10-28/h23-24H,5-22H2,1-4H3
InChIKeyRZWVPIDETOJBOD-UHFFFAOYSA-N
MW498.71 g/mol
LogP1.32
Rot. Bonds10

About 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine

4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine (PubChem CID 54294580) has the molecular formula C26H50N4O5 and a molecular weight of 498.71 g/mol. Its IUPAC name is 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine.

Molecular Properties

Compound Name4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine
PubChem CID54294580
Molecular FormulaC26H50N4O5
Molecular Weight498.71 g/mol
Exact Mass498.38
IUPAC Name4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine
SMILESCCC(N1CCOCC1)C(C)(OC(C)(C(CC)N1CCOCC1)N1CCOCC1)N1CCOCC1
InChIInChI=1S/C26H50N4O5/c1-5-23(27-7-15-31-16-8-27)25(3,29-11-19-33-20-12-29)35-26(4,30-13-21-34-22-14-30)24(6-2)28-9-17-32-18-10-28/h23-24H,5-22H2,1-4H3
InChIKeyRZWVPIDETOJBOD-UHFFFAOYSA-N
XLogP1.32
TPSA59.11 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.71
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine?
The IUPAC name of 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine (CID 54294580) is 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine.
What is the SMILES notation for 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine?
The canonical SMILES for 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine is CCC(N1CCOCC1)C(C)(OC(C)(C(CC)N1CCOCC1)N1CCOCC1)N1CCOCC1.
What is the InChIKey of 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine?
The InChIKey is RZWVPIDETOJBOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H50N4O5/c1-5-23(27-7-15-31-16-8-27)25(3,29-11-19-33-20-12-29)35-26(4,30-13-21-34-22-14-30)24(6-2)28-9-17-32-18-10-28/h23-24H,5-22H2,1-4H3.
What are the key properties of 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine?
4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine has a molecular weight of 498.71 g/mol, XLogP of 1.32, 10 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2,3-dimorpholin-4-ylpentan-2-yloxy)-2-morpholin-4-ylpentan-3-yl]morpholine is sourced from PubChem (CID 54294580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).